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4-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine

  • CAS No. 1370001-96-9

  • Cat. No. CS-0132030
  • Purity≥97%
  • MDL No.MFCD18733395

*For research and further manufacturing use only, not for direct human use.

4-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine|CS-0132030

Structure of 1370001-96-9

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General Information

  • CAS No. 1370001-96-9
  • Cat. No. CS-0132030
  • Purity ≥97%
  • MDL No. MFCD18733395
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₇BN₂O₂
  • Molecular Weight 220.08
  • Synonym(s) (4-METHYLPYRIMIDIN-5-YL)BORONIC ACID PINACOL ESTER
  • SMILES CC1(C)C(C)(C)OB(C2=CN=CN=C2C)O1

Description

4-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine features a boronate ester group enabling direct Suzuki-Miyaura coupling under standard conditions. The pyrimidine core provides a rigid, electron-deficient platform for modular heterocycle synthesis. This bench-stable reagent integrates seamlessly into late-stage functionalization workflows.

Application

4-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine serves as a versatile boronate building block for Suzuki-Miyaura cross-coupling reactions. The pyrimidine core provides a stable, electron-deficient heterocyclic scaffold with excellent functional group tolerance. Bench-stable and readily purified, it enables efficient construction of biaryl and heteroaryl architectures in medicinal chemistry and materials synthesis.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H320-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   44.24
  • LogP   1.08422
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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